ethyl 8-chloranyl-4-oxidanylidene-2-sulfanyl-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 8-chloranyl-4-oxidanylidene-2-sulfanyl-1H-quinoline-3-carboxylate Openeye Name: ethyl 8-chloro-4-oxo-2-sulfanyl-1H-quinoline-3-carboxylate CAS Name: 8-chloro-2-mercapto-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-chloro-4-oxo-2-sulfanyl-1H-quinoline-3-carboxylate Traditional Name: 8-chloro-4-keto-2-mercapto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C12H10ClNO3S MolecularWeight: 283.7307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1=O)C=CC=C2Cl)S

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1=O)C=CC=C2Cl)S

InChI

InChI=1S/C12H10ClNO3S/c1-2-17-12(16)8-10(15)6-4-3-5-7(13)9(6)14-11(8)18/h3-5H,2H2,1H3,(H2,14,15,18)